copper; 2-oxidanidyl-3,5-di(propan-2-yl)benzoate; quinolin-8-olate

Systemtic Name: copper; 2-oxidanidyl-3,5-di(propan-2-yl)benzoate; quinolin-8-olate Openeye Name: copper; 3,5-diisopropyl-2-oxido-benzoate; quinolin-8-olate CAS Name: copper; 2-oxido-3,5-di(propan-2-yl)benzoate; 8-quinolinolate IUPAC Name: copper; 2-oxido-3,5-di(propan-2-yl)benzoate; quinolin-8-olate Traditional Name: cupric; 3,5-diisopropyl-2-oxido-benzoate; quinolin-8-olate Formula: C22H22CuNO4- MolecularWeight: 427.96038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C(=C1)C(=O)[O-])[O-])C(C)C.C1=CC2=C(C(=C1)[O-])N=CC=C2.[Cu+2]

Isomeric SMILES

CC(C)C1=CC(=C(C(=C1)C(=O)[O-])[O-])C(C)C.C1=CC2=C(C(=C1)[O-])N=CC=C2.[Cu+2]

InChI

InChI=1S/C13H18O3.C9H7NO.Cu/c1-7(2)9-5-10(8(3)4)12(14)11(6-9)13(15)16;11-8-5-1-3-7-4-2-6-10-9(7)8;/h5-8,14H,1-4H3,(H,15,16);1-6,11H;/q;;+2/p-3